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BDBM47609 (3E)-2-amino-3-[(3-methoxyphenyl)hydrazinylidene]-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-one::(3E)-2-amino-3-[(3-methoxyphenyl)hydrazono]-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-one::(3E)-2-azanyl-3-[(3-methoxyphenyl)hydrazinylidene]-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-one::2-amino-3-[(3-methoxyphenyl)diazenyl]-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9(4H)-one::MLS000705358::SMR000231770::cid_16189247

SMILES: COc1cccc(c1)N=Nc1c(N)[nH]n2c1nc1CCCCc1c2=O

InChI Key: InChIKey=MBCWSAQIZKXNNE-QZQOTICOSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 47609   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
glutathione S-transferase


(Homo sapiens (Human))
BDBM47609
PNG
((3E)-2-amino-3-[(3-methoxyphenyl)hydrazinylidene]-...)
Show SMILES COc1cccc(c1)N=Nc1c(N)[nH]n2c1nc1CCCCc1c2=O
Show InChI InChI=1S/C17H18N6O2/c1-25-11-6-4-5-10(9-11)20-21-14-15(18)22-23-16(14)19-13-8-3-2-7-12(13)17(23)24/h4-6,9,22H,2-3,7-8,18H2,1H3/b21-20+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/an/an/a 1.22E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-re...


PubChem Bioassay (2010)


Article DOI: 10.1021/cb4000629
BindingDB Entry DOI: 10.7270/Q2ZC8184
More data for this
Ligand-Target Pair